4-Chloro-α-(1-oxopropyl)benzeneacetonitrile
CAS Registry Number®
55474-40-3
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CAS Name
4-Chloro-α-(1-oxopropyl)benzeneacetonitrileMolecular Formula
C11H10ClNOMolecular Mass
207.66Cite this Page
4-Chloro-α-(1-oxopropyl)benzeneacetonitrile. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=55474-40-3 (retrieved ) (CAS RN: 55474-40-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
50-52 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C11H10ClNO/c1-2-11(14)10(7-13)8-3-5-9(12)6-4-8/h3-6,10H,2H2,1H3
InChIKey
InChIKey=NKRGJBDEEGULAN-UHFFFAOYSA-N
SMILES
C(C(CC)=O)(C#N)C1=CC=C(Cl)C=C1
Canonical SMILES
N#CC(C1=CC=C(Cl)C=C1)C(=O)CC
Other Names for this Substance
- Benzeneacetonitrile, 4-chloro-α-(1-oxopropyl)-
- Valeronitrile, 2-(p-chlorophenyl)-3-oxo-
- 4-Chloro-α-(1-oxopropyl)benzeneacetonitrile
- 2-(4-Chlorophenyl)-3-oxopentanenitrile